#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f3h h THR 4 N 0.00 1.20 -0.49 -3.53 2.02 -2.05 0.97 112.91 111.03 3f3h h THR 4 Ca 0.00 -0.39 -0.08 0.00 0.77 0.00 0.00 66.41 66.71 3f3h h THR 4 Cb 0.00 0.08 -0.02 0.00 -1.74 0.00 0.00 68.15 66.47 3f3h h THR 4 CO 0.00 0.20 -0.02 0.00 0.37 0.00 0.00 175.52 176.08 3f3h h ALA 5 N 1.27 1.05 -0.27 6.16 0.00 -2.05 -2.47 119.26 122.95 3f3h h ALA 5 Ca 0.28 -0.28 -0.06 0.00 0.00 0.00 0.00 54.91 54.85 3f3h h ALA 5 Cb -0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.49 3f3h h ALA 5 CO -0.06 0.59 -0.08 1.25 0.00 0.00 0.00 179.25 180.95 3f3h h LEU 6 N 0.77 0.54 -0.45 0.00 5.85 -1.84 -1.26 115.31 118.92 3f3h h LEU 6 Ca 0.14 -0.38 0.06 0.00 0.84 0.00 0.00 57.88 58.55 3f3h h LEU 6 Cb 0.48 -0.15 -0.05 0.00 0.37 0.00 0.00 40.66 41.31 3f3h h LEU 6 CO 0.02 0.80 0.14 0.40 -0.34 0.00 0.00 178.44 179.46 3f3h h ILE 7 N 0.29 0.83 0.00 4.05 2.04 -0.75 -1.40 117.51 122.56 3f3h h ILE 7 Ca 0.07 -0.10 -0.12 0.00 1.00 0.00 0.00 64.86 65.70 3f3h h ILE 7 Cb 0.57 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 3f3h h ILE 7 CO 0.03 0.05 -0.59 -0.26 0.00 0.00 0.00 178.15 177.38 3f3h h PHE 8 N 0.30 0.00 -0.24 1.37 0.04 -1.37 0.33 116.94 117.37 3f3h h PHE 8 Ca 0.21 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.98 3f3h h PHE 8 Cb 0.23 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.37 3f3h h PHE 8 CO -0.17 0.59 0.14 -0.09 -0.60 0.00 0.00 178.31 178.19 3f3h h ARG 9 N 0.00 0.32 -0.15 1.51 2.43 -1.06 -2.50 114.38 114.93 3f3h h ARG 9 Ca -0.01 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.03 3f3h h ARG 9 Cb 1.36 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.83 3f3h h ARG 9 CO 0.08 0.25 -0.38 -0.07 -1.51 0.00 0.00 179.97 178.34 3f3h h LEU 10 N 0.30 0.34 -0.83 3.80 3.38 -0.90 -1.68 115.31 119.72 3f3h h LEU 10 Ca 0.08 -0.14 0.00 0.00 0.09 0.00 0.00 57.88 57.92 3f3h h LEU 10 Cb 0.01 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.62 3f3h h LEU 10 CO -0.02 0.69 0.53 0.00 0.09 0.00 0.00 178.44 179.73 3f3h h ALA 11 N 1.33 1.05 -0.31 1.53 0.00 -0.26 0.15 119.26 122.75 3f3h h ALA 11 Ca 0.03 -0.07 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 3f3h h ALA 11 Cb 0.79 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.25 3f3h h ALA 11 CO 0.06 0.49 -0.42 2.35 0.00 0.00 0.00 179.25 181.73 3f3h h TRP 12 N 1.13 1.01 -0.01 0.00 2.91 -1.19 -1.65 115.95 118.16 3f3h h TRP 12 Ca 0.30 -0.33 -0.03 0.00 1.13 0.00 0.00 58.89 59.96 3f3h h TRP 12 Cb -0.09 -0.20 0.00 0.00 -0.51 0.00 0.00 29.16 28.36 3f3h h TRP 12 CO -0.01 1.14 -0.10 -0.44 -1.03 0.00 0.00 178.44 178.00 3f3h h ASP 13 N 0.60 0.11 -0.00 2.65 5.19 -1.09 -3.39 116.42 120.48 3f3h h ASP 13 Ca 0.03 -0.72 0.00 0.00 -0.62 0.00 0.00 57.03 55.73 3f3h h ASP 13 Cb 1.02 -0.03 0.00 0.00 0.18 0.00 0.00 39.33 40.50 3f3h h ASP 13 CO 0.10 0.81 -0.29 1.33 -3.12 0.00 0.00 179.24 178.07 3f3h n VAL 14 N -4.65 0.00 0.00 -1.35 0.24 0.49 -5.02 118.33 108.05 3f3h n VAL 14 Ca -0.09 -0.35 0.00 0.00 -2.04 0.00 0.00 64.34 61.85 3f3h n VAL 14 Cb 0.41 1.01 0.00 0.00 -1.47 0.00 0.00 33.84 33.79 3f3h n VAL 14 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 3f3h n LYS 15 N -1.05 0.00 -4.51 7.34 4.76 -0.62 -4.73 118.16 119.35 3f3h n LYS 15 Ca 0.01 0.00 -0.26 0.00 -2.87 0.00 0.00 58.31 55.20 3f3h n LYS 15 Cb 0.11 0.00 -0.17 0.00 -1.84 0.00 0.00 35.03 33.13 3f3h n LYS 15 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 3f3h s LYS 16 N 0.00 1.80 -0.15 1.97 2.20 -1.26 -4.86 119.74 119.44 3f3h s LYS 16 Ca 0.00 -0.43 -0.10 0.00 -0.36 0.00 0.00 55.97 55.08 3f3h s LYS 16 Cb 0.00 -1.53 0.05 0.00 -1.51 0.00 0.00 37.83 34.84 3f3h s LYS 16 CO 0.00 -0.01 0.37 -1.17 -0.36 0.00 0.00 175.35 174.17 3f3h s LEU 17 N 0.82 0.24 -0.09 5.43 2.96 -1.26 -5.11 118.68 121.67 3f3h s LEU 17 Ca -0.11 0.78 -0.04 0.00 -0.22 0.00 0.00 54.13 54.53 3f3h s LEU 17 Cb -0.15 1.21 0.05 0.00 0.50 0.00 0.00 46.19 47.80 3f3h s LEU 17 CO 0.02 -0.17 0.20 -0.55 -1.32 0.00 0.00 176.35 174.53 3f3h s SER 18 N 0.94 -0.00 0.11 3.68 0.15 -1.26 -5.17 113.70 112.16 3f3h s SER 18 Ca -0.06 0.42 -0.16 0.00 0.70 0.00 0.00 55.95 56.85 3f3h s SER 18 Cb -0.07 0.34 0.03 0.00 -1.71 0.00 0.00 66.02 64.62 3f3h s SER 18 CO -0.07 -0.18 0.40 0.72 1.20 0.00 0.00 173.24 175.31 3f3h s PHE 19 N 1.50 -0.21 -0.24 3.44 -0.71 -1.26 -4.77 117.98 115.73 3f3h s PHE 19 Ca -0.06 -0.06 -0.04 0.00 -1.04 0.00 0.00 56.93 55.72 3f3h s PHE 19 Cb -0.11 0.25 0.09 0.00 -1.21 0.00 0.00 43.02 42.03 3f3h s PHE 19 CO -0.07 -0.68 0.14 0.34 -1.34 0.00 0.00 175.22 173.61 3f3h s ASP 20 N -2.67 2.72 -0.31 1.98 -1.08 0.12 -4.93 116.67 112.49 3f3h s ASP 20 Ca 0.02 -0.89 0.09 0.00 -0.52 0.00 0.00 52.55 51.25 3f3h s ASP 20 Cb 0.01 -0.16 0.61 0.00 -1.46 0.00 0.00 42.92 41.92 3f3h s ASP 20 CO -0.10 -0.39 1.64 -1.22 0.52 0.00 0.00 175.17 175.62 3f3h n TYR 21 N 5.27 1.83 -1.71 -5.34 4.02 -1.26 -1.87 117.16 118.11 3f3h n TYR 21 Ca -0.06 -1.43 -0.42 0.00 -0.01 0.00 0.00 57.90 55.98 3f3h n TYR 21 Cb 0.46 -0.61 -0.03 0.00 -0.02 0.00 0.00 39.34 39.14 3f3h n TYR 21 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3f3h s THR 22 N -3.12 3.11 0.02 -0.72 2.01 -1.26 -4.92 115.64 110.76 3f3h s THR 22 Ca 0.50 0.13 -0.30 0.00 0.31 0.00 0.00 61.69 62.32 3f3h s THR 22 Cb 0.42 -3.11 -0.07 0.00 0.01 0.00 0.00 72.50 69.76 3f3h s THR 22 CO 0.07 -0.04 1.53 -2.84 -0.69 0.00 0.00 174.62 172.65 3f3h s PRO 23 N 5.21 4.24 -0.38 4.92 0.02 -1.26 -4.38 135.00 143.38 3f3h s PRO 23 Ca 0.91 2.14 -0.04 0.00 0.02 0.00 0.00 61.00 64.02 3f3h s PRO 23 Cb -0.36 -3.63 0.08 0.00 0.02 0.00 0.00 34.50 30.61 3f3h s PRO 23 CO 0.37 -0.67 0.15 -0.80 -0.33 0.00 0.00 177.00 175.73 3f3h s ASN 24 N 2.25 5.24 -0.01 2.53 -0.87 -0.32 -4.95 114.94 118.81 3f3h s ASN 24 Ca 0.69 -1.66 -0.25 0.00 -1.57 0.00 0.00 52.86 50.06 3f3h s ASN 24 Cb -0.35 -1.83 -0.04 0.00 -0.02 0.00 0.00 41.25 39.01 3f3h s ASN 24 CO 0.29 -0.45 0.78 0.26 -2.57 0.00 0.00 177.10 175.40 3f3h s TRP 25 N 1.25 3.65 -0.28 2.20 0.52 -1.26 -0.66 118.94 124.36 3f3h s TRP 25 Ca 0.03 1.42 -0.09 0.00 0.02 0.00 0.00 56.10 57.48 3f3h s TRP 25 Cb -0.22 -2.87 -0.02 0.00 -1.15 0.00 0.00 33.47 29.21 3f3h s TRP 25 CO -0.02 0.14 0.12 0.20 0.02 0.00 0.00 176.95 177.41 3f3h s GLY 26 N 0.52 1.83 0.42 0.98 0.00 0.36 -4.99 107.32 106.45 3f3h s GLY 26 Ca 0.41 -1.22 -0.17 0.00 0.00 0.00 0.00 44.72 43.73 3f3h s GLY 26 CO 0.22 0.62 0.89 0.50 0.00 0.00 0.00 173.10 175.32 3f3h s ARG 27 N 1.64 4.06 0.00 2.90 0.52 -1.26 -0.09 118.95 126.71 3f3h s ARG 27 Ca 0.06 0.90 0.00 0.00 -0.52 0.00 0.00 55.73 56.17 3f3h s ARG 27 Cb -0.16 -2.25 0.00 0.00 0.52 0.00 0.00 34.95 33.06 3f3h s ARG 27 CO 0.06 -0.04 0.00 0.41 0.02 0.00 0.00 175.30 175.74 3f3h n GLY 28 N -0.87 2.72 2.84 -3.53 0.00 0.33 -4.71 105.19 101.96 3f3h n GLY 28 Ca 0.06 -1.94 -0.28 0.00 0.00 0.00 0.00 46.02 43.86 3f3h n GLY 28 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3f3h s ASN 29 N -0.61 2.85 0.80 1.61 2.47 -1.26 -2.95 114.94 117.86 3f3h s ASN 29 Ca 0.00 -0.72 -0.11 0.00 0.42 0.00 0.00 52.86 52.46 3f3h s ASN 29 Cb 0.00 -0.80 0.08 0.00 -1.45 0.00 0.00 41.25 39.08 3f3h s ASN 29 CO 0.00 -0.23 1.11 -2.16 -3.72 0.00 0.00 177.10 172.10 3f3h s PRO 30 N 1.71 1.95 0.27 0.43 0.04 -1.26 -5.04 135.00 133.09 3f3h s PRO 30 Ca -0.00 1.30 0.23 0.00 0.04 0.00 0.00 61.00 62.57 3f3h s PRO 30 Cb -0.16 -1.85 1.01 0.00 0.04 0.00 0.00 34.50 33.54 3f3h s PRO 30 CO -0.07 -1.89 1.70 0.27 0.04 0.00 0.00 177.00 177.04 3f3h n ASN 31 N -3.63 0.64 0.00 6.66 0.23 -1.15 -2.37 115.26 115.64 3f3h n ASN 31 Ca 0.10 0.68 0.11 0.00 -0.53 0.00 0.00 54.58 54.94 3f3h n ASN 31 Cb 0.53 -0.81 0.61 0.00 -2.08 0.00 0.00 39.78 38.03 3f3h n ASN 31 CO 0.00 0.00 0.00 -0.46 -0.93 0.00 0.00 177.26 175.87 3f3h n ASN 32 N -2.24 0.00 -4.76 0.53 6.94 -1.26 -4.50 115.26 109.97 3f3h n ASN 32 Ca 0.01 -0.51 -0.36 0.00 -0.02 0.00 0.00 54.58 53.71 3f3h n ASN 32 Cb 0.19 -0.07 -0.08 0.00 -2.36 0.00 0.00 39.78 37.46 3f3h n ASN 32 CO 0.00 0.00 0.00 -0.36 -1.03 0.00 0.00 177.26 175.87 3f3h s PHE 33 N -2.15 3.41 -0.35 -2.53 0.08 -1.00 -0.74 117.98 114.71 3f3h s PHE 33 Ca 0.29 0.33 -0.18 0.00 0.12 0.00 0.00 56.93 57.49 3f3h s PHE 33 Cb 0.15 -1.99 -0.00 0.00 -0.57 0.00 0.00 43.02 40.61 3f3h s PHE 33 CO 0.27 0.48 0.50 0.42 -0.10 0.00 0.00 175.22 176.78 3f3h s ILE 34 N -0.43 5.03 -0.15 0.64 -1.09 0.18 -0.51 121.20 124.88 3f3h s ILE 34 Ca 0.11 0.30 0.06 0.00 -2.23 0.00 0.00 60.65 58.89 3f3h s ILE 34 Cb -0.12 -3.95 -0.23 0.00 -1.58 0.00 0.00 42.46 36.58 3f3h s ILE 34 CO 0.02 -0.20 0.24 0.47 -1.23 0.00 0.00 174.94 174.23 3f3h n ASP 35 N 5.70 1.29 -3.85 3.58 9.92 0.87 -0.70 116.55 133.37 3f3h n ASP 35 Ca -0.05 0.13 -0.09 0.00 -0.53 0.00 0.00 54.79 54.25 3f3h n ASP 35 Cb 0.49 -0.13 -0.06 0.00 -0.64 0.00 0.00 41.12 40.77 3f3h n ASP 35 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 3f3h s THR 36 N -2.54 0.10 -0.01 -3.53 -4.23 -0.91 -0.70 115.64 103.81 3f3h s THR 36 Ca -0.18 -1.12 0.03 0.00 -1.18 0.00 0.00 61.69 59.24 3f3h s THR 36 Cb 0.07 -1.48 -0.00 0.00 1.34 0.00 0.00 72.50 72.43 3f3h s THR 36 CO 0.76 -0.45 -0.10 0.54 -0.54 0.00 0.00 174.62 174.82 3f3h s VAL 37 N -3.89 0.84 -0.04 2.29 0.11 -0.33 -0.48 120.40 118.90 3f3h s VAL 37 Ca 0.09 -0.43 0.04 0.00 -2.93 0.00 0.00 61.98 58.75 3f3h s VAL 37 Cb 0.04 -0.72 -0.00 0.00 -1.53 0.00 0.00 36.38 34.16 3f3h s VAL 37 CO -0.07 0.25 -0.17 -0.89 -3.33 0.00 0.00 175.10 170.88 3f3h s THR 38 N -0.10 1.45 -0.19 5.04 2.01 0.16 0.06 115.64 124.08 3f3h s THR 38 Ca 0.02 -0.73 -0.05 0.00 0.31 0.00 0.00 61.69 61.24 3f3h s THR 38 Cb -0.06 -1.25 -0.03 0.00 0.01 0.00 0.00 72.50 71.18 3f3h s THR 38 CO -0.00 0.42 -0.01 -0.36 -0.69 0.00 0.00 174.62 173.98 3f3h s PHE 39 N 0.04 3.04 0.35 4.92 0.08 -0.38 -1.18 117.98 124.85 3f3h s PHE 39 Ca -0.04 -0.41 0.02 0.00 0.12 0.00 0.00 56.93 56.62 3f3h s PHE 39 Cb -0.12 -2.05 0.63 0.00 -0.57 0.00 0.00 43.02 40.92 3f3h s PHE 39 CO 0.02 -0.18 2.00 -1.35 -0.10 0.00 0.00 175.22 175.62 3f3h h PRO 40 N 7.26 0.82 -1.91 0.24 0.11 -1.74 -1.06 132.00 135.72 3f3h h PRO 40 Ca -0.35 -0.06 -0.29 0.00 0.11 0.00 0.00 66.00 65.42 3f3h h PRO 40 Cb 1.18 -0.18 -0.31 0.00 0.11 0.00 0.00 31.00 31.80 3f3h h PRO 40 CO 0.62 0.55 -0.61 0.21 -0.21 0.00 0.00 178.00 178.56 3f3h s LYS 41 N -5.69 0.47 0.41 1.05 2.20 -0.78 -2.60 119.74 114.80 3f3h s LYS 41 Ca -0.10 -0.29 -0.02 0.00 -0.36 0.00 0.00 55.97 55.20 3f3h s LYS 41 Cb 0.18 -0.54 -0.03 0.00 -1.51 0.00 0.00 37.83 35.92 3f3h s LYS 41 CO 0.76 -1.09 0.66 0.14 -0.36 0.00 0.00 175.35 175.46 3f3h s VAL 42 N 2.11 5.02 0.60 4.02 -7.23 -1.10 0.10 120.40 123.92 3f3h s VAL 42 Ca 0.12 -0.16 -0.18 0.00 -1.81 0.00 0.00 61.98 59.96 3f3h s VAL 42 Cb -0.13 -3.86 -0.03 0.00 0.56 0.00 0.00 36.38 32.91 3f3h s VAL 42 CO -0.22 -0.69 1.13 -0.76 -0.31 0.00 0.00 175.10 174.25 3f3h s LEU 43 N -4.50 3.59 0.00 1.32 1.43 -1.26 -4.95 118.68 114.31 3f3h s LEU 43 Ca 0.43 2.12 0.00 0.00 -1.03 0.00 0.00 54.13 55.65 3f3h s LEU 43 Cb -0.10 -4.57 0.00 0.00 0.03 0.00 0.00 46.19 41.55 3f3h s LEU 43 CO 0.40 -1.42 0.44 0.35 0.23 0.00 0.00 176.35 176.35 3f3h n THR 44 N -1.79 0.13 0.24 5.49 -2.24 -1.26 -4.81 114.28 110.04 3f3h n THR 44 Ca 0.11 -0.15 0.13 0.00 -2.27 0.00 0.00 64.05 61.87 3f3h n THR 44 Cb 0.51 1.19 0.47 0.00 -2.10 0.00 0.00 70.33 70.40 3f3h n THR 44 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 3f3h h ASP 45 N 0.00 0.00 -3.87 3.42 2.03 -2.04 -3.45 116.42 112.51 3f3h h ASP 45 Ca 0.00 0.00 -0.37 0.00 -0.73 0.00 0.00 57.03 55.93 3f3h h ASP 45 Cb 0.76 0.00 -0.14 0.00 -0.83 0.00 0.00 39.33 39.11 3f3h h ASP 45 CO 0.00 0.12 -0.67 -0.54 -1.03 0.00 0.00 179.24 177.12 3f3h s LYS 46 N -3.54 1.30 -1.38 4.15 1.02 -1.26 -5.06 119.74 114.96 3f3h s LYS 46 Ca 0.02 -1.64 -0.10 0.00 0.02 0.00 0.00 55.97 54.27 3f3h s LYS 46 Cb 0.09 -0.62 0.09 0.00 -0.52 0.00 0.00 37.83 36.86 3f3h s LYS 46 CO 0.61 -0.07 2.19 0.00 -0.92 0.00 0.00 175.35 177.16 3f3h n ALA 47 N -0.39 5.90 -1.77 5.17 0.00 -1.26 -4.98 120.51 123.18 3f3h n ALA 47 Ca -0.06 -4.06 -0.40 0.00 0.00 0.00 0.00 53.44 48.93 3f3h n ALA 47 Cb 0.63 -3.17 0.01 0.00 0.00 0.00 0.00 19.45 16.92 3f3h n ALA 47 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 3f3h s TYR 48 N 1.22 2.63 0.37 0.00 2.02 -1.26 -4.66 117.35 117.66 3f3h s TYR 48 Ca 0.47 1.33 0.07 0.00 -0.37 0.00 0.00 57.07 58.57 3f3h s TYR 48 Cb 0.13 -3.81 -0.07 0.00 -0.40 0.00 0.00 41.96 37.81 3f3h s TYR 48 CO -0.05 -2.55 -0.02 0.95 -1.57 0.00 0.00 175.55 172.32 3f3h s THR 49 N -1.22 1.92 -0.09 -0.71 -4.23 -1.19 -4.68 115.64 105.44 3f3h s THR 49 Ca 0.59 -2.07 0.03 0.00 -1.18 0.00 0.00 61.69 59.06 3f3h s THR 49 Cb -0.41 -2.82 0.01 0.00 1.34 0.00 0.00 72.50 70.62 3f3h s THR 49 CO 0.53 -0.09 -0.19 -0.31 -0.54 0.00 0.00 174.62 174.02 3f3h s TYR 50 N -2.79 2.14 -0.12 3.99 2.02 -1.26 -0.09 117.35 121.24 3f3h s TYR 50 Ca 0.34 -0.87 -0.06 0.00 -0.37 0.00 0.00 57.07 56.10 3f3h s TYR 50 Cb 0.07 -1.47 -0.04 0.00 -0.40 0.00 0.00 41.96 40.12 3f3h s TYR 50 CO 0.17 -0.38 0.12 0.50 -1.57 0.00 0.00 175.55 174.39 3f3h s ARG 51 N 0.51 3.39 -0.10 -0.62 3.52 0.77 -3.64 118.95 122.79 3f3h s ARG 51 Ca -0.16 -0.16 0.04 0.00 -0.13 0.00 0.00 55.73 55.31 3f3h s ARG 51 Cb -0.17 -3.14 -0.00 0.00 -1.56 0.00 0.00 34.95 30.08 3f3h s ARG 51 CO 0.06 0.77 -0.23 0.08 -0.81 0.00 0.00 175.30 175.17 3f3h s VAL 52 N -1.01 2.13 -0.06 7.11 1.01 -0.85 -0.10 120.40 128.63 3f3h s VAL 52 Ca 0.15 -1.00 0.06 0.00 0.00 0.00 0.00 61.98 61.19 3f3h s VAL 52 Cb -0.12 -1.81 -0.01 0.00 0.00 0.00 0.00 36.38 34.44 3f3h s VAL 52 CO 0.04 0.56 -0.24 0.00 0.00 0.00 0.00 175.10 175.46 3f3h s ALA 53 N 0.28 2.23 -0.19 5.51 0.00 0.14 -0.48 121.76 129.24 3f3h s ALA 53 Ca -0.17 -1.04 0.00 0.00 0.00 0.00 0.00 51.96 50.75 3f3h s ALA 53 Cb -0.17 -0.71 0.02 0.00 0.00 0.00 0.00 23.12 22.25 3f3h s ALA 53 CO 0.08 0.43 -0.17 0.08 0.00 0.00 0.00 175.76 176.19 3f3h s VAL 54 N -0.24 2.32 -1.62 0.00 1.01 -0.24 -0.29 120.40 121.33 3f3h s VAL 54 Ca -0.01 -0.88 -0.12 0.00 0.00 0.00 0.00 61.98 60.97 3f3h s VAL 54 Cb -0.13 -2.01 0.11 0.00 0.00 0.00 0.00 36.38 34.35 3f3h s VAL 54 CO 0.03 0.49 0.62 -1.20 0.00 0.00 0.00 175.10 175.04 3f3h n SER 55 N 4.65 -2.11 0.00 3.32 7.64 0.12 -1.60 113.62 125.64 3f3h n SER 55 Ca -0.20 -1.04 0.00 0.00 1.01 0.00 0.00 58.87 58.64 3f3h n SER 55 Cb 0.50 -2.70 0.00 0.00 -1.01 0.00 0.00 64.21 61.00 3f3h n SER 55 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f3h n GLY 56 N -1.64 1.37 3.61 0.23 0.00 -1.26 -5.01 105.19 102.48 3f3h n GLY 56 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 3f3h n GLY 56 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3f3h s ARG 57 N -0.39 4.01 0.08 1.61 6.06 -0.63 -5.06 118.95 124.64 3f3h s ARG 57 Ca 0.00 -0.10 -0.31 0.00 -2.50 0.00 0.00 55.73 52.82 3f3h s ARG 57 Cb 0.00 -3.64 -0.09 0.00 0.06 0.00 0.00 34.95 31.28 3f3h s ARG 57 CO 0.00 -0.19 1.83 1.21 -2.50 0.00 0.00 175.30 175.65 3f3h s ASN 58 N 1.58 6.47 0.01 -2.12 2.47 -1.26 -1.08 114.94 121.01 3f3h s ASN 58 Ca 0.12 2.67 0.23 0.00 0.42 0.00 0.00 52.86 56.29 3f3h s ASN 58 Cb -0.16 -2.55 0.06 0.00 -1.45 0.00 0.00 41.25 37.15 3f3h s ASN 58 CO 0.10 -1.00 1.07 0.18 -3.72 0.00 0.00 177.10 173.73 3f3h n LEU 59 N 6.23 0.72 0.00 3.21 4.77 0.36 -4.95 117.00 127.35 3f3h n LEU 59 Ca 0.18 -0.21 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 3f3h n LEU 59 Cb 0.39 -0.10 0.00 0.00 -2.33 0.00 0.00 43.42 41.39 3f3h n LEU 59 CO 0.66 0.15 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 3f3h n GLY 60 N 1.46 -1.68 3.36 -0.72 0.00 -1.20 -4.90 105.19 101.51 3f3h n GLY 60 Ca 0.04 -1.64 -0.30 0.00 0.00 0.00 0.00 46.02 44.11 3f3h n GLY 60 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f3h s VAL 61 N 0.00 2.21 0.14 1.61 1.01 -1.26 -2.01 120.40 122.10 3f3h s VAL 61 Ca 0.00 -1.47 0.06 0.00 0.00 0.00 0.00 61.98 60.57 3f3h s VAL 61 Cb 0.00 -1.89 -0.04 0.00 0.00 0.00 0.00 36.38 34.44 3f3h s VAL 61 CO 0.00 0.30 -0.13 -0.54 0.00 0.00 0.00 175.10 174.73 3f3h s LYS 62 N -1.45 1.08 0.41 2.72 -0.14 -1.24 -5.05 119.74 116.07 3f3h s LYS 62 Ca 0.12 -1.37 -0.25 0.00 -1.36 0.00 0.00 55.97 53.12 3f3h s LYS 62 Cb -0.10 -0.83 -0.10 0.00 -1.68 0.00 0.00 37.83 35.12 3f3h s LYS 62 CO 0.03 0.14 1.08 -2.30 -0.76 0.00 0.00 175.35 173.54 3f3h n PRO 63 N 0.12 1.49 -2.63 -1.68 -0.02 -1.26 -4.34 135.00 126.68 3f3h n PRO 63 Ca -0.12 0.53 -0.39 0.00 -2.02 0.00 0.00 63.50 61.50 3f3h n PRO 63 Cb 0.59 -2.12 -0.05 0.00 -0.02 0.00 0.00 33.50 31.90 3f3h n PRO 63 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 3f3h s SER 64 N -0.68 7.33 0.38 2.55 0.01 -1.26 -4.97 113.70 117.06 3f3h s SER 64 Ca 0.62 2.05 -0.27 0.00 1.31 0.00 0.00 55.95 59.67 3f3h s SER 64 Cb -0.55 -2.61 -0.09 0.00 0.21 0.00 0.00 66.02 62.98 3f3h s SER 64 CO 0.57 -0.08 1.27 -0.31 0.41 0.00 0.00 173.24 175.11 3f3h s TYR 65 N -1.33 2.94 0.36 2.43 1.51 -1.26 -4.97 117.35 117.04 3f3h s TYR 65 Ca 0.46 1.45 -0.28 0.00 -1.01 0.00 0.00 57.07 57.69 3f3h s TYR 65 Cb -0.26 -3.61 -0.12 0.00 -0.11 0.00 0.00 41.96 37.86 3f3h s TYR 65 CO 0.33 -1.84 1.34 0.00 -1.11 0.00 0.00 175.55 174.27 3f3h n ALA 66 N 0.32 1.60 -1.95 3.71 0.00 -1.26 -4.80 120.51 118.12 3f3h n ALA 66 Ca 0.03 0.34 -0.41 0.00 0.00 0.00 0.00 53.44 53.40 3f3h n ALA 66 Cb 0.44 -2.30 -0.03 0.00 0.00 0.00 0.00 19.45 17.56 3f3h n ALA 66 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 3f3h s VAL 67 N -1.11 2.93 0.82 0.00 1.01 -1.26 -4.77 120.40 118.01 3f3h s VAL 67 Ca 0.55 0.77 -0.12 0.00 0.00 0.00 0.00 61.98 63.18 3f3h s VAL 67 Cb -0.54 -3.49 0.08 0.00 0.00 0.00 0.00 36.38 32.44 3f3h s VAL 67 CO 0.62 0.11 1.10 -1.61 0.00 0.00 0.00 175.10 175.33 3f3h s GLU 68 N -0.11 1.90 0.30 2.72 0.41 -0.29 -4.92 118.70 118.72 3f3h s GLU 68 Ca 0.59 0.58 0.04 0.00 -0.41 0.00 0.00 54.97 55.77 3f3h s GLU 68 Cb -0.39 -1.90 0.64 0.00 -1.78 0.00 0.00 34.13 30.70 3f3h s GLU 68 CO 0.40 -1.73 1.82 1.03 -0.49 0.00 0.00 175.26 176.28 3f3h h SER 69 N -1.17 0.86 0.22 -0.19 0.87 -1.95 -0.05 113.55 112.14 3f3h h SER 69 Ca -0.48 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.15 3f3h h SER 69 Cb 1.28 -0.10 0.00 0.00 -0.44 0.00 0.00 62.40 63.14 3f3h h SER 69 CO 0.60 0.41 0.00 -0.90 -0.53 0.00 0.00 176.83 176.40 3f3h n ASP 70 N -4.66 0.00 0.00 6.23 5.68 -1.26 -4.87 116.55 117.68 3f3h n ASP 70 Ca 0.20 -0.20 0.00 0.00 -0.50 0.00 0.00 54.79 54.29 3f3h n ASP 70 Cb 0.44 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 3f3h n ASP 70 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3f3h n GLY 71 N 0.26 0.70 3.87 6.12 0.00 -0.03 -4.86 105.19 111.25 3f3h n GLY 71 Ca 0.11 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 3f3h n GLY 71 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3f3h s SER 72 N -2.94 6.44 -0.03 1.61 1.04 -1.07 -2.70 113.70 116.05 3f3h s SER 72 Ca 0.00 1.29 0.01 0.00 0.48 0.00 0.00 55.95 57.73 3f3h s SER 72 Cb 0.00 -2.40 0.02 0.00 0.10 0.00 0.00 66.02 63.74 3f3h s SER 72 CO 0.00 -0.60 -0.02 -1.58 0.98 0.00 0.00 173.24 172.02 3f3h s GLN 73 N -4.38 0.45 -0.12 4.02 0.74 -0.40 -1.14 119.66 118.84 3f3h s GLN 73 Ca 0.54 -0.04 -0.04 0.00 0.05 0.00 0.00 55.36 55.87 3f3h s GLN 73 Cb -0.10 -0.53 -0.03 0.00 1.10 0.00 0.00 33.01 33.44 3f3h s GLN 73 CO 0.39 -0.06 0.02 0.21 -0.55 0.00 0.00 175.29 175.31 3f3h s LYS 74 N 0.68 3.31 -0.28 1.67 2.20 -1.26 -1.25 119.74 124.82 3f3h s LYS 74 Ca -0.07 -0.38 -0.08 0.00 -0.36 0.00 0.00 55.97 55.08 3f3h s LYS 74 Cb -0.11 -2.94 -0.01 0.00 -1.51 0.00 0.00 37.83 33.27 3f3h s LYS 74 CO -0.01 0.57 0.09 0.08 -0.36 0.00 0.00 175.35 175.72 3f3h s VAL 75 N -0.51 4.23 -0.44 4.02 1.01 0.11 -4.35 120.40 124.47 3f3h s VAL 75 Ca 0.09 -0.40 -0.15 0.00 0.00 0.00 0.00 61.98 61.52 3f3h s VAL 75 Cb -0.12 -3.08 0.04 0.00 0.00 0.00 0.00 36.38 33.23 3f3h s VAL 75 CO 0.02 0.20 0.35 0.21 0.00 0.00 0.00 175.10 175.88 3f3h s ASN 76 N 1.57 6.13 0.56 3.32 3.84 -1.26 -1.19 114.94 127.92 3f3h s ASN 76 Ca 0.05 -1.08 0.37 0.00 0.21 0.00 0.00 52.86 52.41 3f3h s ASN 76 Cb -0.16 -2.17 1.81 0.00 -0.55 0.00 0.00 41.25 40.17 3f3h s ASN 76 CO 0.04 -0.54 2.12 -0.26 -2.79 0.00 0.00 177.10 175.66 3f3h h PHE 77 N 8.69 0.00 -0.28 0.43 0.04 -1.26 -2.13 116.94 122.43 3f3h h PHE 77 Ca -0.28 0.00 -0.03 0.00 2.80 0.00 0.00 57.97 60.46 3f3h h PHE 77 Cb 1.12 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.25 3f3h h PHE 77 CO 0.59 0.00 0.04 -0.07 -0.60 0.00 0.00 178.31 178.27 3f3h h LEU 78 N 0.00 0.37 -0.85 1.54 4.07 -1.69 0.37 115.31 119.14 3f3h h LEU 78 Ca 0.00 -0.05 -0.08 0.00 0.08 0.00 0.00 57.88 57.83 3f3h h LEU 78 Cb 0.23 -0.10 -0.01 0.00 1.08 0.00 0.00 40.66 41.86 3f3h h LEU 78 CO 0.00 0.41 -0.38 -0.33 -1.08 0.00 0.00 178.44 177.06 3f3h h GLU 79 N 0.40 0.00 0.00 1.13 5.08 -1.71 0.16 114.58 119.64 3f3h h GLU 79 Ca 0.09 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.44 3f3h h GLU 79 Cb 0.21 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.46 3f3h h GLU 79 CO 0.00 0.38 -0.81 1.88 -1.00 0.00 0.00 179.01 179.46 3f3h h TYR 80 N 0.00 0.00 -0.50 4.33 0.05 -1.47 -3.40 116.97 115.97 3f3h h TYR 80 Ca -0.00 0.00 -0.36 0.00 0.05 0.00 0.00 58.73 58.41 3f3h h TYR 80 Cb 0.94 0.00 -0.35 0.00 1.01 0.00 0.00 36.73 38.33 3f3h h TYR 80 CO 0.00 0.07 -0.86 -1.71 -1.05 0.00 0.00 178.16 174.61 3f3h n ASN 81 N -2.81 3.33 -3.00 3.88 5.15 0.05 -4.99 115.26 116.87 3f3h n ASN 81 Ca 0.00 -3.23 -0.22 0.00 -0.60 0.00 0.00 54.58 50.53 3f3h n ASN 81 Cb 0.58 -0.40 0.03 0.00 -0.53 0.00 0.00 39.78 39.46 3f3h n ASN 81 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 3f3h n SER 82 N -0.66 -6.15 0.00 1.20 7.64 -1.14 -2.63 113.62 111.87 3f3h n SER 82 Ca 0.28 -0.28 0.00 0.00 1.01 0.00 0.00 58.87 59.88 3f3h n SER 82 Cb 0.90 -4.98 0.00 0.00 -1.01 0.00 0.00 64.21 59.12 3f3h n SER 82 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f3h n GLY 83 N -1.51 0.58 3.20 0.23 0.00 0.54 -5.06 105.19 103.16 3f3h n GLY 83 Ca -0.12 -0.55 -0.19 0.00 0.00 0.00 0.00 46.02 45.16 3f3h n GLY 83 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f3h s TYR 84 N -2.00 1.31 0.08 1.61 2.02 -1.08 -4.97 117.35 114.33 3f3h s TYR 84 Ca 0.00 -0.49 -0.01 0.00 -0.37 0.00 0.00 57.07 56.20 3f3h s TYR 84 Cb 0.00 -0.72 0.02 0.00 -0.40 0.00 0.00 41.96 40.86 3f3h s TYR 84 CO 0.00 0.09 0.11 0.41 -1.57 0.00 0.00 175.55 174.59 3f3h n GLY 85 N 1.05 -0.82 3.34 0.71 0.00 -1.26 -3.95 105.19 104.25 3f3h n GLY 85 Ca -0.19 -1.72 -0.33 0.00 0.00 0.00 0.00 46.02 43.77 3f3h n GLY 85 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3f3h s ILE 86 N -1.04 2.92 0.24 -0.61 1.01 0.13 -4.87 121.20 118.98 3f3h s ILE 86 Ca 0.06 -0.71 -0.31 0.00 0.00 0.00 0.00 60.65 59.70 3f3h s ILE 86 Cb -0.00 -2.22 -0.14 0.00 0.01 0.00 0.00 42.46 40.11 3f3h s ILE 86 CO 0.04 0.52 1.35 0.00 0.00 0.00 0.00 174.94 176.86 3f3h n ALA 87 N 3.62 0.84 1.49 9.38 0.00 -1.26 0.52 120.51 135.10 3f3h n ALA 87 Ca -0.18 0.41 0.11 0.00 0.00 0.00 0.00 53.44 53.78 3f3h n ALA 87 Cb 0.53 -2.23 0.67 0.00 0.00 0.00 0.00 19.45 18.41 3f3h n ALA 87 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 3f3h n ASP 88 N 1.97 0.00 0.20 0.00 5.68 0.08 -2.02 116.55 122.46 3f3h n ASP 88 Ca 0.11 -0.79 0.12 0.00 -0.50 0.00 0.00 54.79 53.73 3f3h n ASP 88 Cb 0.31 0.00 0.14 0.00 -1.14 0.00 0.00 41.12 40.43 3f3h n ASP 88 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3f3h h THR 89 N 0.00 0.01 -4.28 2.12 1.35 -1.89 -3.47 112.91 106.76 3f3h h THR 89 Ca 0.00 -1.02 -0.50 0.00 -0.55 0.00 0.00 66.41 64.34 3f3h h THR 89 Cb 0.00 1.92 0.09 0.00 -1.73 0.00 0.00 68.15 68.43 3f3h h THR 89 CO 0.00 0.01 0.37 0.20 -0.25 0.00 0.00 175.52 175.85 3f3h s ASN 90 N -6.07 5.44 -0.02 5.36 -0.87 -0.86 -5.05 114.94 112.88 3f3h s ASN 90 Ca 0.06 1.73 -0.25 0.00 -1.57 0.00 0.00 52.86 52.82 3f3h s ASN 90 Cb 0.06 -2.51 -0.04 0.00 -0.02 0.00 0.00 41.25 38.73 3f3h s ASN 90 CO 0.69 -1.40 0.76 -0.89 -2.57 0.00 0.00 177.10 173.70 3f3h s THR 91 N -2.78 4.92 -0.14 1.60 2.01 -1.26 -4.56 115.64 115.44 3f3h s THR 91 Ca 0.61 1.60 0.02 0.00 0.31 0.00 0.00 61.69 64.22 3f3h s THR 91 Cb -0.15 -4.11 0.02 0.00 0.01 0.00 0.00 72.50 68.27 3f3h s THR 91 CO 0.48 0.27 -0.18 -0.63 -0.69 0.00 0.00 174.62 173.87 3f3h s ILE 92 N 0.57 1.80 -0.08 1.82 1.01 0.30 0.12 121.20 126.73 3f3h s ILE 92 Ca 0.40 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 60.28 3f3h s ILE 92 Cb -0.19 -1.62 -0.01 0.00 0.01 0.00 0.00 42.46 40.64 3f3h s ILE 92 CO 0.21 0.50 -0.19 -1.10 0.00 0.00 0.00 174.94 174.36 3f3h s GLN 93 N 1.08 2.86 -0.14 2.79 -0.21 0.60 -0.02 119.66 126.62 3f3h s GLN 93 Ca -0.03 -0.80 0.00 0.00 0.02 0.00 0.00 55.36 54.56 3f3h s GLN 93 Cb -0.14 -2.36 -0.01 0.00 1.00 0.00 0.00 33.01 31.49 3f3h s GLN 93 CO -0.05 0.35 -0.14 0.08 -2.12 0.00 0.00 175.29 173.40 3f3h s VAL 94 N -0.04 2.91 -0.10 1.09 1.01 0.72 -0.69 120.40 125.30 3f3h s VAL 94 Ca -0.05 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.24 3f3h s VAL 94 Cb -0.14 -2.22 -0.01 0.00 0.00 0.00 0.00 36.38 34.00 3f3h s VAL 94 CO 0.05 0.52 -0.18 -0.36 0.00 0.00 0.00 175.10 175.13 3f3h s PHE 95 N 0.48 2.68 -0.10 5.22 0.08 0.86 -0.89 117.98 126.31 3f3h s PHE 95 Ca -0.10 -0.72 -0.22 0.00 0.12 0.00 0.00 56.93 56.01 3f3h s PHE 95 Cb -0.16 -1.75 -0.04 0.00 -0.57 0.00 0.00 43.02 40.51 3f3h s PHE 95 CO 0.05 -0.23 0.65 0.54 -0.10 0.00 0.00 175.22 176.13 3f3h s VAL 96 N 0.16 5.07 -0.20 -0.44 0.11 -0.02 -0.16 120.40 124.92 3f3h s VAL 96 Ca -0.10 1.32 -0.11 0.00 -2.93 0.00 0.00 61.98 60.16 3f3h s VAL 96 Cb -0.16 -3.99 -0.05 0.00 -1.53 0.00 0.00 36.38 30.66 3f3h s VAL 96 CO 0.06 0.24 0.18 -0.69 -3.33 0.00 0.00 175.10 171.56 3f3h s VAL 97 N 0.97 5.37 -0.34 2.04 1.01 0.88 -1.35 120.40 128.97 3f3h s VAL 97 Ca 0.34 0.29 -0.28 0.00 0.00 0.00 0.00 61.98 62.33 3f3h s VAL 97 Cb -0.17 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.70 3f3h s VAL 97 CO 0.15 0.40 1.01 -0.62 0.00 0.00 0.00 175.10 176.04 3f3h s ASP 98 N 0.57 6.82 0.17 3.32 2.15 -0.11 -3.15 116.67 126.45 3f3h s ASP 98 Ca 0.10 0.86 0.19 0.00 0.43 0.00 0.00 52.55 54.14 3f3h s ASP 98 Cb -0.12 -2.51 0.83 0.00 -0.30 0.00 0.00 42.92 40.82 3f3h s ASP 98 CO 0.01 -0.87 1.59 -0.81 -0.17 0.00 0.00 175.17 174.93 3f3h n PRO 99 N 6.83 0.12 0.13 4.34 -0.04 -1.26 0.23 135.00 145.35 3f3h n PRO 99 Ca 0.10 0.39 0.02 0.00 -0.04 0.00 0.00 63.50 63.97 3f3h n PRO 99 Cb 0.48 -1.75 0.03 0.00 -0.04 0.00 0.00 33.50 32.22 3f3h n PRO 99 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3f3h h ASP 100 N 0.00 0.00 0.00 3.54 3.32 -1.96 -3.39 116.42 117.92 3f3h h ASP 100 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3f3h h ASP 100 Cb 0.28 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3f3h h ASP 100 CO 0.00 0.56 -0.61 0.35 -1.72 0.00 0.00 179.24 177.82 3f3h n THR 101 N -3.27 0.00 -0.92 0.35 -2.24 -1.01 -5.02 114.28 102.18 3f3h n THR 101 Ca 0.02 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.80 3f3h n THR 101 Cb 0.74 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.88 3f3h n THR 101 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3f3h n ASN 102 N -1.13 -1.83 -4.77 3.42 4.13 0.14 -5.03 115.26 110.18 3f3h n ASN 102 Ca 0.00 0.00 -0.39 0.00 1.68 0.00 0.00 54.58 55.87 3f3h n ASN 102 Cb 0.13 -1.10 -0.03 0.00 -1.54 0.00 0.00 39.78 37.25 3f3h n ASN 102 CO 0.00 0.00 0.00 0.20 0.28 0.00 0.00 177.26 177.74 3f3h s ASN 103 N -2.37 6.70 0.22 6.41 0.01 -1.25 -4.78 114.94 119.88 3f3h s ASN 103 Ca 0.00 2.36 0.10 0.00 -0.71 0.00 0.00 52.86 54.61 3f3h s ASN 103 Cb 0.00 -2.62 -0.05 0.00 0.41 0.00 0.00 41.25 38.99 3f3h s ASN 103 CO 0.00 -0.56 -0.18 1.51 -1.51 0.00 0.00 177.10 176.36 3f3h s ASP 104 N -1.03 3.05 -0.02 -1.22 3.84 -1.26 -0.94 116.67 119.10 3f3h s ASP 104 Ca 0.54 -0.97 0.01 0.00 -0.00 0.00 0.00 52.55 52.12 3f3h s ASP 104 Cb -0.32 -0.21 0.02 0.00 -1.38 0.00 0.00 42.92 41.03 3f3h s ASP 104 CO 0.40 -0.03 -0.01 -0.36 -0.00 0.00 0.00 175.17 175.17 3f3h s PHE 105 N -2.47 0.32 0.20 2.11 0.08 -0.46 -4.93 117.98 112.84 3f3h s PHE 105 Ca 0.24 -0.03 -0.32 0.00 0.12 0.00 0.00 56.93 56.93 3f3h s PHE 105 Cb -0.04 -0.34 -0.12 0.00 -0.57 0.00 0.00 43.02 41.94 3f3h s PHE 105 CO 0.10 -0.09 1.70 1.51 -0.10 0.00 0.00 175.22 178.34 3f3h n ILE 106 N 3.75 0.01 0.00 0.64 0.13 -1.26 -0.84 119.36 121.79 3f3h n ILE 106 Ca -0.22 -0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.43 3f3h n ILE 106 Cb 0.53 -1.90 0.00 0.00 -0.84 0.00 0.00 39.64 37.43 3f3h n ILE 106 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3f3h n ILE 107 N 3.87 0.00 -3.66 9.51 0.13 -0.06 -4.87 119.36 124.28 3f3h n ILE 107 Ca 0.16 -0.07 -0.10 0.00 -1.10 0.00 0.00 62.75 61.64 3f3h n ILE 107 Cb 0.34 0.56 -0.08 0.00 -0.84 0.00 0.00 39.64 39.61 3f3h n ILE 107 CO 0.00 0.00 0.00 0.00 2.80 0.00 0.00 176.55 179.35 3f3h s ALA 108 N -0.41 -1.60 -0.05 1.51 0.00 -1.04 -4.79 121.76 115.37 3f3h s ALA 108 Ca 0.00 2.02 -0.01 0.00 0.00 0.00 0.00 51.96 53.97 3f3h s ALA 108 Cb 0.00 -1.19 0.03 0.00 0.00 0.00 0.00 23.12 21.96 3f3h s ALA 108 CO 0.00 -0.33 0.02 -1.14 0.00 0.00 0.00 175.76 174.31 3f3h s GLN 109 N 1.12 0.29 -0.23 0.00 0.74 -1.26 -0.20 119.66 120.11 3f3h s GLN 109 Ca -0.06 0.19 -0.13 0.00 0.05 0.00 0.00 55.36 55.41 3f3h s GLN 109 Cb -0.05 -0.68 -0.05 0.00 1.10 0.00 0.00 33.01 33.33 3f3h s GLN 109 CO -0.11 -0.26 0.26 -0.46 -0.55 0.00 0.00 175.29 174.16 3f3h s TRP 110 N 1.76 3.32 0.00 1.67 -0.11 0.97 -4.96 118.94 121.59 3f3h s TRP 110 Ca 0.01 0.35 0.00 0.00 1.22 0.00 0.00 56.10 57.68 3f3h s TRP 110 Cb -0.13 -2.39 0.00 0.00 -1.50 0.00 0.00 33.47 29.46 3f3h s TRP 110 CO -0.03 -0.01 0.00 0.09 -4.62 0.00 0.00 176.95 172.38